Vitas-M small molecule compound
dipropan-2-yl 5-{[(4-chlorobenzyl)carbamothioyl]amino}benzene-1,3-dicarboxylate
Catalog ID
STK455559
SMILES CC(OC(=O)c1cc(NC(=S)NCc2ccc(cc2)Cl)cc(c1)C(=O)OC(C)C)C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H25ClN2O4S MW 448.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25ClN2O4S/c1-13(2)28-20(26)16-9-17(21(27)29-14(3)4)11-19(10-16)25-22(30)24-12-15-5-7-18(23)8-6-15/h5-11,13-14H,12H2,1-4H3,(H2,24,25,30)InChIKey
RZRCKDQJKYMADM-UHFFFAOYSA-NSynonyms
CC(C)OC(=O)C1=CC(=CC(=C1)NC(=S)NCC2=CC=C(C=C2)Cl)C(=O)OC(C)C
dipropan2yl5(((4chlorobenzyl)carbamothioyl)amino)benzene13dicarboxylate
DIPROPAN2YL5((4CHLOROPHENYL)METHYLCARBAMOTHIOYLAMINO)BENZENE13DICARBOXYLATE
InChI=1SC22H25ClN2O4Sc113(2)2820(26)16917(21(27)2914(3)4)1119(1016)2522(30)2412155718(23)8615h5111314H12H214H3(H2242530)
METHYLETHYL5(((((4CHLOROPHENYL)METHYL)AMINO)THIOXOMETHYL)AMINO)3((METHYLETHYL)OXYCARBONYL)BENZOATE
MFCD04227398
ZINC000002853740
ZINC02853740
ZINC2853740
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